5-[[4-cyano-5-(1-hydroxyethyl)-1H-imidazol-2-yl]methyl]-2-phenyl-benzoic acid

Systemtic Name: 5-[[4-cyano-5-(1-hydroxyethyl)-1H-imidazol-2-yl]methyl]-2-phenyl-benzoic acid Openeye Name: 5-[[4-cyano-5-(1-hydroxyethyl)-1H-imidazol-2-yl]methyl]-2-phenyl-benzoic acid CAS Name: 5-[[4-cyano-5-(1-hydroxyethyl)-1H-imidazol-2-yl]methyl]-2-phenylbenzoic acid IUPAC Name: 5-[[4-cyano-5-(1-hydroxyethyl)-1H-imidazol-2-yl]methyl]-2-phenylbenzoic acid Traditional Name: 5-[[4-cyano-5-(1-hydroxyethyl)-1H-imidazol-2-yl]methyl]-2-phenyl-benzoic acid Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(N=C(N1)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O)C#N)O

Isomeric SMILES

CC(C1=C(N=C(N1)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O)C#N)O

InChI

InChI=1S/C20H17N3O3/c1-12(24)19-17(11-21)22-18(23-19)10-13-7-8-15(16(9-13)20(25)26)14-5-3-2-4-6-14/h2-9,12,24H,10H2,1H3,(H,22,23)(H,25,26)